106555-77-5
Product Name:
Acetic acid, 2-[(5-hydroxypentyl)oxy]-, ethyl ester
Formula:
C9H18O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 190.24 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 9 |
| Exact Mass | 190.12050905 g/mol |
| Monoisotopic Mass | 190.12050905 g/mol |
| Topological Polar Surface Area | 55.8 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 125 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |